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Carbamic acid,N-(2-pyridinylmethyl)-, 1,1-dimethylethyl ester

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Name

Carbamic acid,N-(2-pyridinylmethyl)-, 1,1-dimethylethyl ester

EINECS N/A
CAS No. 134807-28-6 Density 1.074 g/cm3
PSA 51.22000 LogP 2.49720
Solubility N/A Melting Point N/A
Formula C11H16N2O2 Boiling Point 330 °C at 760 mmHg
Molecular Weight 208.26 Flash Point 153.4 °C
Transport Information N/A Appearance N/A
Safety 26-36/37 Risk Codes 22-36/37/38-43
Molecular Structure Molecular Structure of 134807-28-6 (N-BOC-2-AMINOMETHYLPYRIDINE  97) Hazard Symbols HarmfulXn
Synonyms

N-Boc-2-(aminomethyl)pyridine;

Article Data 20

Carbamic acid,N-(2-pyridinylmethyl)-, 1,1-dimethylethyl ester Specification

The Carbamic acid,N-(2-pyridinylmethyl)-, 1,1-dimethylethyl ester, with the CAS registry number of 134807-28-6, is also known as N-Boc-2-(aminomethyl)pyridine. It belongs to the product categories of N-BOC; Heterocyclic Compounds. This chemical's molecular formula is C11H16N2O2 and molecular weight is 208.25694. What's more, its systematic name is tert-Butyl (pyridin-2-ylmethyl)carbamate.

Physical properties about the Carbamic acid,N-(2-pyridinylmethyl)-, 1,1-dimethylethyl ester are: (1)ACD/LogP: 1.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.36; (4)ACD/LogD (pH 7.4): 1.4; (5)ACD/BCF (pH 5.5): 6.23; (6)ACD/BCF (pH 7.4): 6.81; (7)ACD/KOC (pH 5.5): 125.66; (8)ACD/KOC (pH 7.4): 137.4; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 51.22 Å2; (13)Index of Refraction: 1.507; (14)Molar Refractivity: 57.76 cm3; (15)Molar Volume: 193.8 cm3; (16)Surface Tension: 39.1 dyne/cm; (17)Density: 1.074 g/cm3; (18)Flash Point: 153.4 °C; (19)Enthalpy of Vaporization: 57.25 kJ/mol; (20)Boiling Point: 330 °C at 760 mmHg; (21)Vapour Pressure: 0.000171 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In addition, during using it, wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1) SMILES: CC(C)(C)OC(=O)NCc1ccccn1
(2) InChI: InChI=1/C11H16N2O2/c1-11(2,3)15-10(14)13-8-9-6-4-5-7-12-9/h4-7H,8H2,1-3H3,(H,13,14)
(3) InChIKey: RKVWMMAKYQABGS-UHFFFAOYAW

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